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SMILES: C(C(=O)O)c1n[nH]c2c(cccc12)Br Canonical SMILES: OC(=O)Cc1n[nH]c2c1cccc2Br InChI: InChI=1S/C9H7BrN2O2/c10-6-3-1-2-5-7(4-8(13)14)11-12-9(5)6/h1-3H,4H2,(H,11,12)(H,13,14) InChIKey: HXCQKIZTKCSVDT-UHFFFAOYSA-N
CBID:803542 http://www.chembase.cn/molecule-803542.html